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Geometry for HCP (Phosphaethyne) 1Σ C*V

1910171554
InChI=1S/CHP/c1-2/h1H INChIKey=DPYPSJGRRFKXBE-UHFFFAOYSA-N

B1B95/6-31G*


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.9986
H2 0.0000 0.0000 -2.0728
P3 0.0000 0.0000 0.5376
Atom - Atom Distances (Å)
  C1 H2 P3
C1 1.0741 1.5362
H2 1.0741 2.6104
P3 1.5362 2.6104
Maximum atom distance is 2.6104Å between atoms H2 and P3.
picture of Phosphaethyne
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 P3 180.000

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.